2-(furan-3-ylmethoxy)-N-methylethanamine

C8H13NO2 — CID 83171444

IUPAC2-(furan-3-ylmethoxy)-N-methylethanamine
SMILESCNCCOCc1ccoc1
InChIInChI=1S/C8H13NO2/c1-9-3-5-11-7-8-2-4-10-6-8/h2,4,6,9H,3,5,7H2,1H3
InChIKeyBDWIPZATQYZMNB-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.02
Rot. Bonds5

About 2-(furan-3-ylmethoxy)-N-methylethanamine

2-(furan-3-ylmethoxy)-N-methylethanamine (PubChem CID 83171444) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-(furan-3-ylmethoxy)-N-methylethanamine.

Molecular Properties

Compound Name2-(furan-3-ylmethoxy)-N-methylethanamine
PubChem CID83171444
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name2-(furan-3-ylmethoxy)-N-methylethanamine
SMILESCNCCOCc1ccoc1
InChIInChI=1S/C8H13NO2/c1-9-3-5-11-7-8-2-4-10-6-8/h2,4,6,9H,3,5,7H2,1H3
InChIKeyBDWIPZATQYZMNB-UHFFFAOYSA-N
XLogP1.02
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-ylmethoxy)-N-methylethanamine?
The IUPAC name of 2-(furan-3-ylmethoxy)-N-methylethanamine (CID 83171444) is 2-(furan-3-ylmethoxy)-N-methylethanamine.
What is the SMILES notation for 2-(furan-3-ylmethoxy)-N-methylethanamine?
The canonical SMILES for 2-(furan-3-ylmethoxy)-N-methylethanamine is CNCCOCc1ccoc1.
What is the InChIKey of 2-(furan-3-ylmethoxy)-N-methylethanamine?
The InChIKey is BDWIPZATQYZMNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-9-3-5-11-7-8-2-4-10-6-8/h2,4,6,9H,3,5,7H2,1H3.
What are the key properties of 2-(furan-3-ylmethoxy)-N-methylethanamine?
2-(furan-3-ylmethoxy)-N-methylethanamine has a molecular weight of 155.20 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-ylmethoxy)-N-methylethanamine is sourced from PubChem (CID 83171444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).